SCHEMBL1768438

SCHEMBL1768438

COc1cccc(C(=O)NCc2noc(-c3c4ccccc4nn3CCc3ncc[nH]3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.59
SCN4A P35499 2/20 0.59
SCN5A Q14524 2/20 0.59
SCN9A Q15858 2/20 0.59
SCN2A Q99250 2/20 0.59
SCN3A Q9NY46 2/20 0.59
SCN8A Q9UQD0 2/20 0.59
SCN10A Q9Y5Y9 2/20 0.59
NAMPT P43490 2/20 0.46
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
PTGER4 P35408 1/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.40
AURKA O14965 1/20 0.40
NPC1 O15118 1/20 0.39
PKM P14618 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13582897 0.83 SCN1A (0.82) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL1768554 0.77 CYP2D6 (0.68) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL1768481 0.74 SCN1A (0.71) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL1768494 0.74 SCN1A (1.00) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL1768420 0.73 SCN8A (0.76) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL1768208 0.72 SCN8A (0.52) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL19286473 0.72 NAMPT (0.72) NAMPTRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL12648966 0.71 SCN8A (0.76) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL13583942 0.70 SCN8A (0.52) SCN1ASCN4ASCN5ASCN9ASCN2A
SCHEMBL13583699 0.68 SCN1A (0.64) SCN1ASCN4ASCN5ASCN9ASCN2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2483270-A1 INDAZOLE DERIVATIVES AND THEIR USE FOR BLOCKADING VOLTAGE DEPENDENT SODIUM CHANNELS University College London (GB) 2012-08-08 EP disclosed
WO-2011061469-A1 INDAZOLE DERIVATIVES AND THEIR USE FOR BLOCKADING VOLTAGE DEPENDENT SODIUM CHANNELS UNIVERSITY COLLEGE LONDON (GB) 2011-05-26 WO disclosed